CompoundList
Sign in
Aromatic building blocks

Torquatone

Also known as 3-methyl-1-(2,4,6-trimethoxy-3,5-dimethylphenyl)butan-1-one, 3-methyl-1-(2,4,6-trimethoxy-3,5-dimethylphenyl)-1-butanone

CAS 3567-96-2Formula C16H24O4Molar mass 280.36 g/mol
Get quotes Safety data
Torquatone chemical structure, C16H24O4, CAS 3567-96-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
3567-96-2
Formula
C16H24O4
Molar mass
280.36 g/mol
HS code
291450
Category
Aromatic building blocks

What is Torquatone?

Plain description, key identifiers and synonyms

torquatone has been reported in Eucalyptus sparsa, Eucalyptus stoatei, and other organisms.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-methyl-1-(2,4,6-trimethoxy-3,5-dimethylphenyl)butan-1-one
CAS number
3567-96-2 CAS number cross-checked
Molecular formula
C16H24O4
InChIKey
PYUCCSKQLHUKCA-UHFFFAOYSA-N
InChI
InChI=1S/C16H24O4/c1-9(2)8-12(17)13-15(19-6)10(3)14(18-5)11(4)16(13)20-7/h9H,8H2,1-7H3
SMILES (canonical and isomeric)
CC1=C(C(=C(C(=C1OC)C(=O)CC(C)C)OC)C)OC

Synonyms

  • 3-methyl-1-(2,4,6-trimethoxy-3,5-dimethylphenyl)butan-1-one
  • 3-methyl-1-(2,4,6-trimethoxy-3,5-dimethylphenyl)-1-butanone

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
280.36 g/molcalc.
Exact mass
280.1675 Dacalc.
LogP (octanol/water)
3.56calc.
Topological polar surface area
44.76 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
6calc.
Heavy atoms
20calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.56calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Torquatone suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade Torquatone can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Torquatone price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Torquatone is traded under.

HS 2914.50Indicative HS code

Ketone-phenols and ketones with other oxygen function

World exports in 2024
$438M
+10.9% vs 2023, imports $420M
2019 to 2024
Top exporters
  1. China50.5%
  2. India * partner reported11.6%
  3. United States11.3%
Top importers
  1. United States20.8%
  2. Germany10.0%
  3. Netherlands8.6%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Torquatone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Torquatone, based on the data on this page

What is Torquatone?

torquatone has been reported in Eucalyptus sparsa, Eucalyptus stoatei, and other organisms.

What is the CAS number of Torquatone?

The CAS registry number of Torquatone is 3567-96-2.

What is the molecular formula and weight of Torquatone?

The molecular formula of Torquatone is C16H24O4 and its molar mass is 280.36 g/mol.

What is Torquatone used for?

Known uses and roles of Torquatone include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Torquatone hazardous?

No GHS hazard classification for Torquatone is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Torquatone?

Torquatone is usually classified under HS code 291450 (Ketone-phenols and ketones with other oxygen function). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Torquatone?

Post a free request on CompoundList and suppliers of Torquatone will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Torquatone?

Suppliers quote Torquatone on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Torquatone

Get quotes for Torquatone

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Torquatone
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Torquatone with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/torquatone-3567-96-2" title="Torquatone structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Aromatic building blocks or HS code 291450

Price on request
Free quotes, contact stays private
Get quotes